propyl 2-thianthren-2-ylbutanoate

Systemtic Name: propyl 2-thianthren-2-ylbutanoate Openeye Name: propyl 2-thianthren-2-ylbutanoate CAS Name: 2-(2-thianthrenyl)butanoic acid propyl ester IUPAC Name: propyl 2-thianthren-2-ylbutanoate Traditional Name: 2-thianthren-2-ylbutyric acid propyl ester Formula: C19H20O2S2 MolecularWeight: 344.4909

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(CC)C1=CC2=C(C=C1)SC3=CC=CC=C3S2

Isomeric SMILES

CCCOC(=O)C(CC)C1=CC2=C(C=C1)SC3=CC=CC=C3S2

InChI

InChI=1S/C19H20O2S2/c1-3-11-21-19(20)14(4-2)13-9-10-17-18(12-13)23-16-8-6-5-7-15(16)22-17/h5-10,12,14H,3-4,11H2,1-2H3